ChemSpider 2D Image | Gentamicin A sulfate | C18H36N4O10

Gentamicin A sulfate

  • Molecular FormulaC18H36N4O10
  • Average mass468.499 Da
  • Monoisotopic mass468.243134 Da
  • ChemSpider ID30791434

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1R,2S,3S,4R,6S)-4,6-Diamino-3-{[3-deoxy-3-(methylamino)-α-D-xylopyranosyl]oxy}-2-hydroxycyclohexyl 2-amino-2-deoxy-α-D-glucopyranoside [ACD/IUPAC Name]
(1R,2S,3S,4R,6S)-4,6-Diamino-3-{[3-desoxy-3-(methylamino)-α-D-xylopyranosyl]oxy}-2-hydroxycyclohexyl-2-amino-2-desoxy-α-D-glucopyranosid [German] [ACD/IUPAC Name]
13291-74-2 [RN]
2-Amino-2-désoxy-α-D-glucopyranoside de (1R,2S,3S,4R,6S)-4,6-diamino-3-{[3-désoxy-3-(méthylamino)-α-D-xylopyranosyl]oxy}-2-hydroxycyclohexyle [French] [ACD/IUPAC Name]
Gentamicin A sulfate
α-D-Glucopyranoside, (1R,2S,3S,4R,6S)-4,6-diamino-3-[[3-deoxy-3-(methylamino)-α-D-xylopyranosyl]oxy]-2-hydroxycyclohexyl 2-amino-2-deoxy- [ACD/Index Name]
(2R,3S,4R,5R,6S)-5-Amino-6-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(2R,3R,4S,5S)-3,5-dihydroxy-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-2-(hydroxymethyl)oxane-3,4-diol
[13291-74-2] [RN]
gentamicin A
MFCD00153295

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 772.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 128.3±6.0 kJ/mol
Flash Point: 421.2±32.9 °C
Index of Refraction: 1.642
Molar Refractivity: 109.7±0.4 cm3
#H bond acceptors: 14
#H bond donors: 13
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -2.26
ACD/LogD (pH 5.5): -8.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 248 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 89.8±5.0 dyne/cm
Molar Volume: 303.7±5.0 cm3

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